N-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide

C22H15N5O — CID 59292872

IUPACN-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide
SMILESO=C(Nc1ncc[nH]1)c1ccc(-c2cccc3ccccc23)c2nccnc12
InChIInChI=1S/C22H15N5O/c28-21(27-22-25-12-13-26-22)18-9-8-17(19-20(18)24-11-10-23-19)16-7-3-5-14-4-1-2-6-15(14)16/h1-13H,(H2,25,26,27,28)
InChIKeyVITZPQFDAKITGL-UHFFFAOYSA-N
MW365.40 g/mol
LogP4.43
Rot. Bonds3

About N-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide

N-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide (PubChem CID 59292872) has the molecular formula C22H15N5O and a molecular weight of 365.40 g/mol. Its IUPAC name is N-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide.

Molecular Properties

Compound NameN-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide
PubChem CID59292872
Molecular FormulaC22H15N5O
Molecular Weight365.40 g/mol
Exact Mass365.13
IUPAC NameN-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide
SMILESO=C(Nc1ncc[nH]1)c1ccc(-c2cccc3ccccc23)c2nccnc12
InChIInChI=1S/C22H15N5O/c28-21(27-22-25-12-13-26-22)18-9-8-17(19-20(18)24-11-10-23-19)16-7-3-5-14-4-1-2-6-15(14)16/h1-13H,(H2,25,26,27,28)
InChIKeyVITZPQFDAKITGL-UHFFFAOYSA-N
XLogP4.43
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.40
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide?
The IUPAC name of N-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide (CID 59292872) is N-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide.
What is the SMILES notation for N-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide?
The canonical SMILES for N-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide is O=C(Nc1ncc[nH]1)c1ccc(-c2cccc3ccccc23)c2nccnc12.
What is the InChIKey of N-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide?
The InChIKey is VITZPQFDAKITGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15N5O/c28-21(27-22-25-12-13-26-22)18-9-8-17(19-20(18)24-11-10-23-19)16-7-3-5-14-4-1-2-6-15(14)16/h1-13H,(H2,25,26,27,28).
What are the key properties of N-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide?
N-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide has a molecular weight of 365.40 g/mol, XLogP of 4.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-2-yl)-8-naphthalen-1-ylquinoxaline-5-carboxamide is sourced from PubChem (CID 59292872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).